ethyl 1-[9-(ethanoylsulfanylmethyl)-10-oxidanylidene-azecan-2-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: ethyl 1-[9-(ethanoylsulfanylmethyl)-10-oxidanylidene-azecan-2-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: ethyl 1-[9-(acetylsulfanylmethyl)-10-oxo-azecane-2-carbonyl]pyrrolidine-2-carboxylate CAS Name: 1-[[9-[(acetylthio)methyl]-10-oxo-2-azecanyl]-oxomethyl]-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[9-(acetylsulfanylmethyl)-10-oxoazecane-2-carbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-[9-[(acetylthio)methyl]-10-keto-azecane-2-carbonyl]pyrrolidine-2-carboxylic acid ethyl ester Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN1C(=O)C2CCCCCCC(C(=O)N2)CSC(=O)C

Isomeric SMILES

CCOC(=O)C1CCCN1C(=O)C2CCCCCCC(C(=O)N2)CSC(=O)C

InChI

InChI=1S/C20H32N2O5S/c1-3-27-20(26)17-11-8-12-22(17)19(25)16-10-7-5-4-6-9-15(18(24)21-16)13-28-14(2)23/h15-17H,3-13H2,1-2H3,(H,21,24)